SCHEMBL12696282

SCHEMBL12696282

C[n+]1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccccc2)c2ccccc2n4-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ SLC22A2 O15244 1/20 0.43
▸ SLC22A1 O15245 1/20 0.43
▸ SLC22A3 O75751 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43
▸ TSPO P30536 1/20 0.39
▸ QDPR P09417 2/20 0.37
▸ PTGER4 P35408 1/20 0.37
▸ IL1R1 P14778 1/20 0.37
▸ HDAC4 P56524 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ACHE P22303 2/20 0.35
▸ BCHE P06276 1/20 0.35
▸ MAPK8 P45983 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15423847 0.89 L3MBTL1 (0.44) L3MBTL1KDM4EATMSLC22A2SLC22A1
SCHEMBL19501103 0.88 L3MBTL1 (0.64) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL19769566 0.87 L3MBTL1 (0.62) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL21376301 0.87 L3MBTL1 (0.62) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL18085705 0.87 L3MBTL1 (0.62) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL15338028 0.87 L3MBTL1 (0.67) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL19653538 0.85 L3MBTL1 (0.60) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL19652776 0.85 L3MBTL1 (0.60) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL19863527 0.85 L3MBTL1 (0.60) L3MBTL1KDM4EATMTSPOPTGER4
SCHEMBL17759438 0.85 L3MBTL1 (0.60) L3MBTL1KDM4EATMTSPOPTGER4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9923152-B2 Organic ionic functional materials MERCK PATENT GMBH (DE) 2018-03-20 — — US disclosed
US-9923152-B2 Organic ionic functional materials MERCK PATENT GMBH (DE) 2018-03-20 — — US disclosed
US-20140014885-A1 ORGANIC IONIC FUNCTIONAL MATERIALS MERCK PATENT GMBH (DE) 2014-01-16 — — US disclosed
US-20140014885-A1 ORGANIC IONIC FUNCTIONAL MATERIALS MERCK PATENT GMBH (DE) 2014-01-16 — — US disclosed
WO-2012126566-A1 ORGANIC IONIC FUNCTIONAL MATERIALS MERCK PATENT GMBH (DE) 2012-09-27 — — WO disclosed
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